Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mim_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N ASP 1.A O no hydrogen 3.267 N/A LYS 5.A NZ ASP 1.A OD2 no hydrogen 3.402 N/A LEU 6.A N ARG 2.A O no hydrogen 3.001 N/A LEU 7.A N ALA 3.A O no hydrogen 3.107 N/A THR 8.A N THR 4.A O no hydrogen 3.060 N/A THR 8.A OG1 THR 4.A O no hydrogen 2.956 N/A TYR 9.A N LYS 5.A O no hydrogen 3.040 N/A TYR 9.A OH TYR 541.A O no hydrogen 2.869 N/A LEU 10.A N LEU 6.A O no hydrogen 2.882 N/A ALA 11.A N LEU 7.A O no hydrogen 2.814 N/A ASP 12.A N THR 8.A O no hydrogen 2.949 N/A VAL 13.A N TYR 9.A O no hydrogen 2.984 N/A THR 14.A N LEU 10.A O no hydrogen 2.753 N/A THR 14.A OG1 LEU 10.A O no hydrogen 2.797 N/A VAL 15.A N ALA 11.A O no hydrogen 3.014 N/A ASN 16.A N ASP 12.A O no hydrogen 2.894 N/A GLY 17.A N VAL 13.A O no hydrogen 2.850 N/A HIS 18.A NE2 TYR 541.A OH no hydrogen 3.115 N/A GLU 20.A N HIS 18.A ND1 no hydrogen 3.100 N/A ALA 21.A N HIS 18.A O no hydrogen 2.895 N/A LYS 22.A N HIS 18.A O no hydrogen 2.765 N/A ARG 24.A N ALA 21.A O no hydrogen 3.427 N/A ARG 24.A NE GLU 20.A O no hydrogen 3.176 N/A GLY 47.A N GLN 50.A OE1 no hydrogen 3.002 N/A THR 48.A OG1 LEU 108.A O no hydrogen 3.291 N/A THR 48.A OG1 LEU 109.A O no hydrogen 2.760 N/A LYS 49.A N ASN 143.A O no hydrogen 2.836 N/A LYS 49.A NZ ASP 179.A OD1 no hydrogen 3.280 N/A GLN 50.A N GLY 47.A O no hydrogen 3.193 N/A GLN 50.A NE2 PRO 142.A O no hydrogen 2.997 N/A LEU 51.A N GLY 47.A O no hydrogen 3.465 N/A LEU 52.A N THR 48.A O no hydrogen 2.983 N/A ASP 53.A N LYS 49.A O no hydrogen 3.026 N/A THR 54.A N GLN 50.A O no hydrogen 2.999 N/A THR 54.A OG1 GLN 50.A O no hydrogen 2.972 N/A LEU 55.A N LEU 51.A O no hydrogen 2.866 N/A GLY 56.A N LEU 52.A O no hydrogen 2.926 N/A PHE 60.A N GLY 56.A O no hydrogen 3.094 N/A GLY 61.A N PRO 57.A O no hydrogen 2.956 N/A GLU 62.A N LYS 58.A O no hydrogen 3.029 N/A TRP 63.A N LYS 59.A O no hydrogen 2.855 N/A MET 64.A N PHE 60.A O no hydrogen 2.822 N/A ARG 65.A N GLY 61.A O no hydrogen 2.921 N/A ARG 65.A NH1 THR 269.A O no hydrogen 2.638 N/A ARG 65.A NH1 LEU 271.A O no hydrogen 2.569 N/A ARG 65.A NH2 ARG 266.A O no hydrogen 2.534 N/A ARG 65.A NH2 THR 269.A O no hydrogen 3.171 N/A ASN 66.A N GLU 62.A O no hydrogen 2.965 N/A GLU 67.A N TRP 63.A O no hydrogen 3.117 N/A GLU 67.A N MET 64.A O no hydrogen 3.206 N/A ARG 69.A NE GLU 67.A OE2 no hydrogen 3.092 N/A ARG 69.A NH1 ASN 107.A O no hydrogen 3.142 N/A VAL 70.A N ARG 327.A O no hydrogen 3.133 N/A LEU 71.A N ASP 297.A O no hydrogen 2.902 N/A THR 73.A N VAL 299.A O no hydrogen 3.067 N/A THR 73.A OG1 SER 110.A OG no hydrogen 2.634 N/A THR 73.A OG1 HIS 274.A NE2 no hydrogen 3.080 N/A ASP 74.A N SER 110.A O no hydrogen 3.202 N/A THR 75.A N ALA 301.A O no hydrogen 2.939 N/A THR 75.A OG1 ALA 301.A O no hydrogen 3.032 N/A THR 76.A N ASP 74.A OD1 no hydrogen 2.816 N/A THR 76.A OG1 ASP 74.A OD1 no hydrogen 2.568 N/A ARG 78.A N THR 75.A O no hydrogen 2.882 N/A ARG 78.A NE GLU 112.A OE1 no hydrogen 3.021 N/A ARG 78.A NE GLU 112.A OE2 no hydrogen 3.305 N/A ARG 78.A NH1 GLU 112.A OE1 no hydrogen 3.367 N/A ARG 78.A NH1 GLU 112.A OE2 no hydrogen 2.805 N/A ARG 78.A NH2 GLN 82.A OE1 no hydrogen 2.821 N/A ASP 79.A N GLU 112.A OE1 no hydrogen 3.252 N/A GLY 80.A N THR 75.A O no hydrogen 3.125 N/A HIS 81.A NE2 MET 77.A O no hydrogen 2.828 N/A GLN 82.A N ARG 78.A O no hydrogen 2.966 N/A SER 83.A N ASP 79.A O no hydrogen 2.922 N/A SER 83.A OG ASP 79.A O no hydrogen 2.831 N/A SER 83.A OG ASP 79.A OD1 no hydrogen 3.403 N/A SER 83.A OG THR 310.A O no hydrogen 3.479 N/A LEU 84.A N GLY 80.A O no hydrogen 3.163 N/A LEU 85.A N HIS 81.A O no hydrogen 2.854 N/A THR 87.A N HIS 81.A O no hydrogen 2.902 N/A ARG 88.A N LEU 85.A O no hydrogen 3.061 N/A ARG 88.A NH1 ALA 86.A O no hydrogen 2.867 N/A ARG 88.A NH2 GLU 20.A OE1 no hydrogen 2.803 N/A ARG 90.A N TYR 350.A OH no hydrogen 2.853 N/A ARG 90.A NH1 LEU 536.A O no hydrogen 2.792 N/A ARG 90.A NH1 THR 538.A OG1 no hydrogen 3.061 N/A ARG 90.A NH2 LEU 536.A O no hydrogen 3.002 N/A THR 91.A N GLU 128.A OE2 no hydrogen 2.847 N/A THR 91.A OG1 GLU 128.A OE2 no hydrogen 2.945 N/A ASP 93.A N ARG 90.A O no hydrogen 3.076 N/A ILE 94.A N ARG 90.A O no hydrogen 3.035 N/A ALA 95.A N THR 91.A O no hydrogen 2.874 N/A ALA 98.A N ALA 95.A O no hydrogen 3.055 N/A TYR 101.A N ILE 97.A O no hydrogen 3.174 N/A TYR 101.A OH ASP 74.A OD1 no hydrogen 3.410 N/A TYR 101.A OH ASP 74.A OD2 no hydrogen 2.631 N/A SER 102.A N ALA 98.A O no hydrogen 3.098 N/A SER 102.A OG ASN 143.A OD1 no hydrogen 2.798 N/A HIS 103.A N GLY 99.A O no hydrogen 2.869 N/A HIS 103.A ND1 GLY 99.A O no hydrogen 2.958 N/A ALA 104.A N THR 100.A O no hydrogen 2.858 N/A LEU 105.A N TYR 101.A O no hydrogen 2.732 N/A LEU 108.A N LEU 105.A O no hydrogen 3.286 N/A LEU 109.A N LEU 72.A O no hydrogen 2.782 N/A SER 110.A OG THR 73.A OG1 no hydrogen 2.634 N/A SER 110.A OG GLN 147.A OE1 no hydrogen 2.697 N/A LEU 111.A N LEU 145.A O no hydrogen 3.039 N/A GLU 112.A N ASP 74.A O no hydrogen 2.865 N/A CYS 113.A N GLN 147.A O no hydrogen 2.887 N/A CYS 113.A SG LEU 111.A O no hydrogen 3.582 N/A TRP 114.A NE1 PRO 130.A O no hydrogen 2.889 N/A GLY 116.A N LEU 149.A O no hydrogen 3.101 N/A ALA 117.A N GLN 82.A OE1 no hydrogen 2.821 N/A THR 118.A N GLY 115.A O no hydrogen 3.187 N/A THR 118.A OG1 GLY 115.A O no hydrogen 2.416 N/A VAL 121.A N ALA 117.A O no hydrogen 3.172 N/A SER 122.A N THR 118.A O no hydrogen 3.101 N/A SER 122.A OG THR 118.A O no hydrogen 3.039 N/A SER 122.A OG PHE 119.A O no hydrogen 3.052 N/A SER 122.A OG GLU 128.A O no hydrogen 3.300 N/A ARG 124.A N ASP 120.A O no hydrogen 2.934 N/A ARG 124.A NH2 ASP 120.A OD1 no hydrogen 2.807 N/A ARG 124.A NH2 ASP 120.A OD2 no hydrogen 2.907 N/A PHE 125.A N VAL 121.A O no hydrogen 2.654 N/A LEU 126.A N VAL 121.A O no hydrogen 3.229 N/A THR 127.A OG1 TYR 541.A OH no hydrogen 2.807 N/A GLU 128.A N SER 122.A O no hydrogen 2.782 N/A TRP 131.A N ASP 129.A OD1 no hydrogen 2.453 N/A TRP 131.A NE1 SER 512.A OG no hydrogen 2.783 N/A ARG 133.A N ASP 129.A O no hydrogen 3.284 N/A ARG 133.A NE THR 91.A OG1 no hydrogen 2.738 N/A ARG 133.A NH2 GLU 128.A OE2 no hydrogen 2.928 N/A LEU 134.A N PRO 130.A O no hydrogen 3.085 N/A ALA 135.A N TRP 131.A O no hydrogen 2.841 N/A LEU 136.A N GLU 132.A O no hydrogen 2.879 N/A ILE 137.A N ARG 133.A O no hydrogen 3.079 N/A ARG 138.A N LEU 134.A O no hydrogen 2.850 N/A ARG 138.A NE ARG 138.A O no hydrogen 3.155 N/A ARG 138.A NH1 GLY 177.A O no hydrogen 3.443 N/A ARG 138.A NH1 ASP 179.A OD2 no hydrogen 2.702 N/A ARG 138.A NH2 ALA 141.A O no hydrogen 2.630 N/A ARG 138.A NH2 LEU 144.A O no hydrogen 2.690 N/A GLU 139.A N ALA 135.A O no hydrogen 3.132 N/A GLY 140.A N LEU 136.A O no hydrogen 2.950 N/A ALA 141.A N ILE 137.A O no hydrogen 2.902 N/A ASN 143.A ND2 LYS 45.A O no hydrogen 3.136 N/A ASN 143.A ND2 SER 102.A O no hydrogen 3.183 N/A LEU 146.A N ASP 179.A OD2 no hydrogen 2.624 N/A GLN 147.A N LEU 111.A O no hydrogen 2.817 N/A MET 148.A N LEU 180.A O no hydrogen 3.078 N/A LEU 149.A N TRP 114.A O no hydrogen 3.090 N/A LEU 150.A N ARG 182.A O no hydrogen 2.790 N/A ARG 151.A N GLY 155.A O no hydrogen 3.022 N/A ARG 151.A NH1 GLY 157.A O no hydrogen 2.850 N/A ASN 154.A N ARG 151.A O no hydrogen 2.816 N/A GLY 155.A N GLY 152.A O no hydrogen 3.188 N/A GLY 157.A N ASN 154.A O no hydrogen 2.825 N/A TYR 158.A OH ASP 120.A OD2 no hydrogen 2.408 N/A TYR 161.A N ALA 153.A O no hydrogen 3.130 N/A TYR 161.A OH MET 515.A O no hydrogen 2.742 N/A ASN 164.A ND2 ALA 488.A O no hydrogen 2.988 N/A VAL 165.A N PRO 162.A O no hydrogen 2.958 N/A VAL 166.A N PRO 162.A O no hydrogen 3.110 N/A LYS 167.A N ASP 163.A O no hydrogen 2.927 N/A TYR 168.A N ASN 164.A O no hydrogen 3.172 N/A PHE 169.A N VAL 165.A O no hydrogen 2.882 N/A VAL 170.A N VAL 166.A O no hydrogen 3.022 N/A ARG 171.A N LYS 167.A O no hydrogen 2.931 N/A GLN 172.A N TYR 168.A O no hydrogen 2.976 N/A GLN 172.A NE2 TYR 168.A O no hydrogen 3.679 N/A ALA 173.A N PHE 169.A O no hydrogen 2.828 N/A ALA 174.A N VAL 170.A O no hydrogen 3.181 N/A LYS 175.A N ARG 171.A O no hydrogen 3.244 N/A LYS 175.A NZ GLN 172.A OE1 no hydrogen 2.981 N/A GLY 176.A N GLN 172.A O no hydrogen 2.716 N/A GLY 177.A N ALA 173.A O no hydrogen 3.166 N/A GLY 177.A N ALA 174.A O no hydrogen 3.028 N/A ILE 178.A N ALA 173.A O no hydrogen 3.065 N/A ASP 179.A N LEU 146.A O no hydrogen 2.921 N/A LEU 180.A N LEU 146.A O no hydrogen 3.061 N/A PHE 181.A N LEU 206.A O no hydrogen 2.854 N/A ARG 182.A N MET 148.A O no hydrogen 2.986 N/A ARG 182.A NE GLU 208.A OE2 no hydrogen 2.732 N/A ARG 182.A NH1 ASP 300.A OD2 no hydrogen 2.582 N/A ARG 182.A NH2 GLU 208.A OE2 no hydrogen 2.949 N/A ARG 182.A NH2 ASP 300.A OD1 no hydrogen 3.268 N/A ARG 182.A NH2 ASP 300.A OD2 no hydrogen 3.090 N/A VAL 183.A N GLU 208.A O no hydrogen 2.896 N/A PHE 184.A N LEU 150.A O no hydrogen 3.171 N/A LEU 187.A N ASP 185.A OD2 no hydrogen 2.999 N/A ASN 188.A N ASP 185.A O no hydrogen 3.020 N/A ASN 188.A ND2 CYS 212.A O no hydrogen 2.928 N/A ASN 188.A ND2 TYR 229.A OH no hydrogen 2.976 N/A TRP 189.A N ASP 185.A OD2 no hydrogen 3.134 N/A ASN 192.A N TRP 189.A O no hydrogen 2.988 N/A MET 193.A N VAL 190.A O no hydrogen 2.770 N/A MET 197.A N MET 193.A O no hydrogen 2.876 N/A ASP 198.A N ARG 194.A O no hydrogen 2.834 N/A ALA 199.A N VAL 195.A O no hydrogen 2.851 N/A ILE 200.A N SER 196.A O no hydrogen 2.942 N/A ALA 201.A N MET 197.A O no hydrogen 3.106 N/A GLU 202.A N ASP 198.A O no hydrogen 2.931 N/A GLU 203.A N ALA 199.A O no hydrogen 3.157 N/A GLU 203.A N ILE 200.A O no hydrogen 3.160 N/A ASN 204.A N ALA 201.A O no hydrogen 2.797 N/A LYS 205.A N ILE 200.A O no hydrogen 3.253 N/A LEU 206.A N ASP 179.A O no hydrogen 2.953 N/A GLU 208.A N PHE 181.A O no hydrogen 2.929 N/A ALA 209.A N ILE 244.A O no hydrogen 2.963 N/A ALA 210.A N VAL 183.A O no hydrogen 2.724 N/A ILE 211.A N ALA 246.A O no hydrogen 2.897 N/A CYS 212.A N ASN 188.A OD1 no hydrogen 2.937 N/A THR 214.A N TYR 230.A OH no hydrogen 2.936 N/A GLY 215.A N GLU 368.A OE2 no hydrogen 3.273 N/A ILE 217.A N TYR 213.A OH no hydrogen 3.084 N/A LEU 218.A N ASP 216.A OD1 no hydrogen 3.030 N/A ASN 219.A N ASP 216.A O no hydrogen 3.268 N/A ALA 221.A N ASN 219.A OD1 no hydrogen 2.803 N/A ARG 222.A N ASN 219.A O no hydrogen 2.805 N/A ARG 222.A NE ASP 406.A OD2 no hydrogen 3.211 N/A ARG 222.A NH1 GLU 368.A OE2 no hydrogen 3.013 N/A ARG 222.A NH2 GLU 368.A OE1 no hydrogen 3.110 N/A ARG 222.A NH2 GLU 368.A OE2 no hydrogen 2.889 N/A ARG 222.A NH2 ASP 406.A OD1 no hydrogen 3.016 N/A LYS 224.A NZ GLY 405.A O no hydrogen 2.753 N/A LYS 224.A NZ ASP 406.A O no hydrogen 3.047 N/A TYR 225.A OH ASP 406.A O no hydrogen 2.622 N/A LYS 228.A NZ ASP 226.A OD2 no hydrogen 2.645 N/A TYR 229.A N ASP 226.A O no hydrogen 3.143 N/A TYR 229.A N ASP 226.A OD1 no hydrogen 2.950 N/A TYR 230.A OH THR 214.A O no hydrogen 2.722 N/A THR 231.A N LEU 227.A O no hydrogen 3.242 N/A THR 231.A OG1 LYS 228.A O no hydrogen 3.549 N/A ASN 232.A N LYS 228.A O no hydrogen 2.950 N/A LEU 233.A N TYR 229.A O no hydrogen 3.231 N/A ALA 234.A N TYR 230.A O no hydrogen 2.927 N/A VAL 235.A N THR 231.A O no hydrogen 3.090 N/A GLU 236.A N ASN 232.A O no hydrogen 2.854 N/A LEU 237.A N LEU 233.A O no hydrogen 2.871 N/A GLU 238.A N ALA 234.A O no hydrogen 3.027 N/A LYS 239.A N VAL 235.A O no hydrogen 3.070 N/A ALA 240.A N GLU 236.A O no hydrogen 3.063 N/A GLY 241.A N GLU 238.A O no hydrogen 2.800 N/A ALA 242.A N LEU 237.A O no hydrogen 3.051 N/A HIS 243.A N CYS 207.A O no hydrogen 2.868 N/A ILE 244.A N CYS 207.A O no hydrogen 3.297 N/A ILE 245.A N PRO 272.A O no hydrogen 2.969 N/A ALA 246.A N ALA 209.A O no hydrogen 2.914 N/A VAL 247.A N HIS 274.A O no hydrogen 2.902 N/A GLY 251.A N ASP 248.A O no hydrogen 3.033 N/A LEU 252.A N ASP 248.A OD1 no hydrogen 2.836 N/A LEU 253.A N ASP 248.A OD1 no hydrogen 3.447 N/A LEU 253.A N ASP 248.A OD2 no hydrogen 2.920 N/A LYS 254.A NZ ASP 216.A OD2 no hydrogen 2.921 N/A ALA 258.A N LYS 254.A O no hydrogen 2.973 N/A LYS 259.A N PRO 255.A O no hydrogen 3.226 N/A LEU 261.A N ALA 257.A O no hydrogen 2.873 N/A PHE 262.A N ALA 258.A O no hydrogen 2.854 N/A LYS 263.A N LYS 259.A O no hydrogen 3.326 N/A LYS 263.A NZ GLU 267.A OE2 no hydrogen 3.217 N/A ALA 264.A N VAL 260.A O no hydrogen 3.071 N/A LEU 265.A N LEU 261.A O no hydrogen 2.931 N/A ARG 266.A N PHE 262.A O no hydrogen 3.013 N/A ARG 266.A NH2 ASP 297.A OD2 no hydrogen 3.293 N/A GLU 267.A N ALA 264.A O no hydrogen 3.091 N/A ALA 268.A N ALA 264.A O no hydrogen 2.886 N/A ALA 268.A N LEU 265.A O no hydrogen 3.014 N/A THR 269.A N LEU 265.A O no hydrogen 3.012 N/A THR 269.A OG1 GLU 238.A OE1 no hydrogen 2.523 N/A LEU 271.A N THR 269.A OG1 no hydrogen 3.289 N/A ILE 273.A N ASP 297.A OD2 no hydrogen 2.901 N/A HIS 274.A N ILE 245.A O no hydrogen 2.869 N/A HIS 274.A ND1 GLU 208.A OE1 no hydrogen 2.504 N/A HIS 274.A NE2 ASP 300.A OD1 no hydrogen 2.805 N/A PHE 275.A N ALA 298.A O no hydrogen 2.919 N/A HIS 276.A N VAL 247.A O no hydrogen 2.835 N/A HIS 276.A ND1 ASP 300.A OD2 no hydrogen 2.840 N/A THR 277.A OG1 ASP 248.A OD2 no hydrogen 2.526 N/A HIS 278.A N THR 277.A OG1 no hydrogen 2.763 N/A HIS 278.A ND1 THR 310.A O no hydrogen 2.591 N/A ASP 279.A N SER 311.A O no hydrogen 2.945 N/A GLY 282.A N ASP 279.A O no hydrogen 2.924 N/A ILE 283.A N SER 281.A OG no hydrogen 3.079 N/A ALA 284.A N ASP 279.A OD1 no hydrogen 2.835 N/A ALA 286.A N ILE 283.A O no hydrogen 2.771 N/A THR 287.A N ILE 283.A O no hydrogen 3.353 N/A THR 287.A OG1 LEU 253.A O no hydrogen 2.739 N/A VAL 288.A N ALA 284.A O no hydrogen 2.926 N/A LEU 289.A N ALA 285.A O no hydrogen 3.046 N/A LEU 289.A N ALA 286.A O no hydrogen 3.204 N/A ALA 290.A N ALA 286.A O no hydrogen 3.031 N/A ALA 291.A N THR 287.A O no hydrogen 2.908 N/A VAL 292.A N VAL 288.A O no hydrogen 2.980 N/A GLU 293.A N LEU 289.A O no hydrogen 2.749 N/A ALA 294.A N ALA 290.A O no hydrogen 2.868 N/A ALA 294.A N ALA 291.A O no hydrogen 3.125 N/A GLY 295.A N VAL 292.A O no hydrogen 2.909 N/A VAL 296.A N ALA 291.A O no hydrogen 3.204 N/A ASP 297.A N ILE 273.A O no hydrogen 3.076 N/A ALA 298.A N ILE 273.A O no hydrogen 3.080 N/A VAL 299.A N LEU 71.A O no hydrogen 2.947 N/A ASP 300.A N PHE 275.A O no hydrogen 3.043 N/A ALA 301.A N THR 73.A O no hydrogen 2.944 N/A ALA 302.A N PRO 313.A O no hydrogen 3.239 N/A MET 303.A N THR 76.A OG1 no hydrogen 3.056 N/A ALA 305.A N SER 340.A OG no hydrogen 2.924 N/A LEU 306.A N MET 303.A O no hydrogen 2.786 N/A SER 307.A N ASP 304.A O no hydrogen 2.878 N/A SER 307.A OG ASP 304.A O no hydrogen 2.638 N/A GLY 308.A N GLN 312.A O no hydrogen 2.797 N/A THR 310.A OG1 SER 83.A O no hydrogen 3.176 N/A SER 311.A N GLY 308.A O no hydrogen 2.906 N/A SER 311.A OG LEU 306.A O no hydrogen 2.699 N/A GLN 312.A NE2 THR 75.A OG1 no hydrogen 2.860 N/A CYS 314.A SG SER 317.A OG no hydrogen 3.761 N/A LEU 315.A N ALA 302.A O no hydrogen 2.832 N/A GLY 316.A N ASP 304.A OD1 no hydrogen 2.850 N/A ILE 318.A N CYS 314.A O no hydrogen 3.058 N/A VAL 319.A N LEU 315.A O no hydrogen 2.949 N/A GLU 320.A N GLY 316.A O no hydrogen 2.846 N/A ALA 321.A N SER 317.A O no hydrogen 2.960 N/A LEU 322.A N VAL 319.A O no hydrogen 2.821 N/A SER 323.A N VAL 319.A O no hydrogen 3.021 N/A GLY 324.A N ASP 328.A OD2 no hydrogen 3.290 N/A SER 325.A N LEU 322.A O no hydrogen 2.823 N/A SER 325.A OG LEU 322.A O no hydrogen 2.971 N/A ARG 327.A NE LYS 68.A O no hydrogen 2.784 N/A ARG 327.A NH1 VAL 292.A O no hydrogen 3.037 N/A ARG 327.A NH1 VAL 296.A O no hydrogen 2.839 N/A ARG 327.A NH2 LYS 68.A O no hydrogen 3.119 N/A ARG 327.A NH2 ARG 69.A O no hydrogen 3.332 N/A ARG 327.A NH2 VAL 296.A O no hydrogen 2.955 N/A ASP 328.A N SER 325.A O no hydrogen 3.026 N/A GLY 330.A N ASP 328.A OD1 no hydrogen 2.732 N/A ALA 334.A N ASP 332.A OD1 no hydrogen 3.078 N/A ILE 336.A N ASP 332.A O no hydrogen 3.219 N/A ARG 337.A N PRO 333.A O no hydrogen 2.891 N/A ARG 338.A N ALA 334.A O no hydrogen 3.016 N/A ILE 339.A N TRP 335.A O no hydrogen 2.975 N/A SER 340.A N ILE 336.A O no hydrogen 2.909 N/A PHE 341.A N ARG 337.A O no hydrogen 2.735 N/A TYR 342.A N ARG 338.A O no hydrogen 3.197 N/A TYR 342.A OH ASP 93.A O no hydrogen 2.451 N/A TRP 343.A N ILE 339.A O no hydrogen 2.970 N/A TRP 343.A NE1 TYR 101.A OH no hydrogen 3.055 N/A GLU 344.A N SER 340.A O no hydrogen 2.715 N/A ALA 345.A N PHE 341.A O no hydrogen 3.037 N/A VAL 346.A N TYR 342.A O no hydrogen 2.752 N/A ARG 347.A N TRP 343.A O no hydrogen 2.710 N/A ARG 347.A NE GLU 354.A OE2 no hydrogen 2.805 N/A ARG 347.A NH1 ALA 305.A O no hydrogen 2.852 N/A ARG 347.A NH2 GLU 354.A OE1 no hydrogen 2.878 N/A ARG 347.A NH2 GLU 354.A OE2 no hydrogen 3.413 N/A ASN 348.A N GLU 344.A O no hydrogen 3.224 N/A GLN 349.A N VAL 346.A O no hydrogen 3.094 N/A TYR 350.A N ARG 347.A O no hydrogen 2.817 N/A TYR 350.A OH ASP 93.A OD2 no hydrogen 2.792 N/A ALA 351.A N ASN 348.A O no hydrogen 3.369 N/A PHE 353.A N TYR 350.A O no hydrogen 2.955 N/A GLU 354.A N ALA 351.A O no hydrogen 3.363 N/A LEU 357.A N SER 355.A OG no hydrogen 3.020 N/A ALA 361.A N THR 280.A O no hydrogen 2.936 N/A VAL 364.A N ALA 361.A O no hydrogen 3.228 N/A TYR 365.A N SER 362.A O no hydrogen 2.844 N/A LEU 366.A N GLU 363.A O no hydrogen 2.922 N/A HIS 367.A N GLU 363.A O no hydrogen 3.084 N/A GLU 368.A N VAL 364.A O no hydrogen 2.933 N/A MET 369.A N HIS 367.A ND1 no hydrogen 3.013 N/A GLY 371.A N MET 249.A O no hydrogen 3.043 N/A GLN 373.A N PRO 370.A O no hydrogen 3.017 N/A GLN 373.A NE2 SER 414.A O no hydrogen 2.904 N/A PHE 374.A N PRO 370.A O no hydrogen 3.246 N/A LEU 377.A N GLN 373.A O no hydrogen 2.722 N/A LYS 378.A N PHE 374.A O no hydrogen 2.921 N/A GLU 379.A N THR 375.A O no hydrogen 2.872 N/A GLN 380.A N ASN 376.A O no hydrogen 2.821 N/A ALA 381.A N LEU 377.A O no hydrogen 2.848 N/A ARG 382.A N LYS 378.A O no hydrogen 3.015 N/A ARG 382.A NE GLU 379.A OE1 no hydrogen 3.209 N/A SER 383.A N GLU 379.A O no hydrogen 2.878 N/A SER 383.A OG GLN 380.A O no hydrogen 3.450 N/A LEU 384.A N GLN 380.A O no hydrogen 3.091 N/A LEU 384.A N ALA 381.A O no hydrogen 3.105 N/A GLY 385.A N ARG 382.A O no hydrogen 2.802 N/A LEU 386.A N ALA 381.A O no hydrogen 2.874 N/A ARG 389.A N LEU 386.A O no hydrogen 2.698 N/A TRP 390.A N GLU 387.A O no hydrogen 3.446 N/A HIS 391.A ND1 GLU 363.A OE2 no hydrogen 2.843 N/A VAL 393.A N ARG 389.A O no hydrogen 3.125 N/A ALA 394.A N TRP 390.A O no hydrogen 2.903 N/A GLN 395.A N HIS 391.A O no hydrogen 2.937 N/A GLN 395.A NE2 ASP 399.A OD1 no hydrogen 2.964 N/A ALA 396.A N GLN 392.A O no hydrogen 2.741 N/A TYR 397.A N VAL 393.A O no hydrogen 2.643 N/A TYR 397.A OH GLN 373.A OE1 no hydrogen 2.709 N/A ALA 398.A N ALA 394.A O no hydrogen 3.103 N/A ASP 399.A N GLN 395.A O no hydrogen 2.970 N/A ALA 400.A N ALA 396.A O no hydrogen 2.728 N/A ASN 401.A N TYR 397.A O no hydrogen 3.020 N/A ASN 401.A ND2 ASP 406.A OD1 no hydrogen 3.058 N/A GLN 402.A N ALA 398.A O no hydrogen 3.154 N/A MET 403.A N ASP 399.A O no hydrogen 2.810 N/A PHE 404.A N ALA 400.A O no hydrogen 3.032 N/A GLY 405.A N GLN 402.A O no hydrogen 2.810 N/A ASP 406.A N ASN 401.A O no hydrogen 2.847 N/A ILE 407.A N ASN 401.A OD1 no hydrogen 3.012 N/A LYS 409.A NZ GLU 368.A OE1 no hydrogen 2.805 N/A LYS 409.A NZ ILE 407.A O no hydrogen 3.320 N/A VAL 410.A N SER 413.A OG no hydrogen 3.063 N/A SER 413.A OG CYS 186.A O no hydrogen 3.281 N/A SER 413.A OG VAL 408.A O no hydrogen 2.631 N/A SER 413.A OG VAL 410.A O no hydrogen 2.940 N/A SER 414.A N VAL 410.A O no hydrogen 3.156 N/A LYS 415.A NZ ASP 419.A OD2 no hydrogen 2.763 N/A VAL 417.A N SER 413.A O no hydrogen 3.203 N/A GLY 418.A N SER 414.A O no hydrogen 2.951 N/A ASP 419.A N LYS 415.A O no hydrogen 2.888 N/A MET 420.A N VAL 416.A O no hydrogen 2.968 N/A ALA 421.A N VAL 417.A O no hydrogen 2.881 N/A LEU 422.A N GLY 418.A O no hydrogen 3.035 N/A MET 423.A N ASP 419.A O no hydrogen 3.126 N/A MET 424.A N MET 420.A O no hydrogen 3.059 N/A VAL 425.A N ALA 421.A O no hydrogen 2.997 N/A SER 426.A N LEU 422.A O no hydrogen 2.900 N/A SER 426.A OG LEU 422.A O no hydrogen 3.029 N/A GLN 427.A N MET 423.A O no hydrogen 2.854 N/A ASP 428.A N VAL 425.A O no hydrogen 3.073 N/A LEU 429.A N MET 424.A O no hydrogen 2.798 N/A THR 430.A N ASP 433.A OD2 no hydrogen 2.965 N/A THR 430.A OG1 ASP 433.A OD2 no hydrogen 3.109 N/A ASP 433.A N THR 430.A OG1 no hydrogen 2.916 N/A VAL 434.A N THR 430.A O no hydrogen 2.774 N/A VAL 435.A N VAL 431.A O no hydrogen 3.113 N/A SER 436.A N ASP 433.A O no hydrogen 2.973 N/A ASP 438.A N SER 436.A OG no hydrogen 3.239 N/A ARG 439.A N SER 436.A O no hydrogen 3.432 N/A SER 446.A OG ASP 419.A OD2 no hydrogen 2.697 N/A VAL 447.A N PRO 444.A O no hydrogen 3.049 N/A VAL 448.A N PRO 444.A O no hydrogen 3.081 N/A SER 449.A N GLU 445.A O no hydrogen 2.851 N/A SER 449.A OG ASP 454.A OD2 no hydrogen 2.439 N/A MET 450.A N SER 446.A O no hydrogen 2.824 N/A LEU 451.A N VAL 447.A O no hydrogen 2.921 N/A LYS 452.A N VAL 448.A O no hydrogen 2.699 N/A LYS 452.A NZ GLU 474.A OE1 no hydrogen 2.958 N/A GLY 453.A N SER 449.A O no hydrogen 3.244 N/A GLY 453.A N MET 450.A O no hydrogen 2.877 N/A ASP 454.A N SER 449.A O no hydrogen 3.160 N/A GLY 456.A N GLY 453.A O no hydrogen 2.938 N/A GLY 461.A N PRO 458.A O no hydrogen 3.017 N/A TRP 462.A NE1 GLY 456.A O no hydrogen 3.266 N/A GLN 467.A N PRO 463.A O no hydrogen 3.097 N/A GLN 467.A NE2 LEU 451.A O no hydrogen 3.253 N/A LYS 468.A N GLU 464.A O no hydrogen 2.772 N/A LYS 469.A N ALA 465.A O no hydrogen 3.049 N/A LYS 469.A NZ VAL 434.A O no hydrogen 2.857 N/A LYS 469.A NZ SER 436.A O no hydrogen 2.934 N/A LYS 469.A NZ ARG 439.A O no hydrogen 2.767 N/A ALA 470.A N LEU 466.A O no hydrogen 2.733 N/A LEU 471.A N GLN 467.A O no hydrogen 3.049 N/A GLU 474.A N LEU 471.A O no hydrogen 3.123 N/A TYR 477.A N LYS 452.A O no hydrogen 3.076 N/A TYR 477.A OH ASP 454.A OD1 no hydrogen 2.381 N/A ARG 480.A NH1 ASP 163.A OD2 no hydrogen 2.755 N/A SER 483.A N ARG 480.A O no hydrogen 3.062 N/A SER 483.A OG ARG 480.A O no hydrogen 2.785 N/A LEU 484.A N PRO 481.A O no hydrogen 2.981 N/A LEU 485.A N GLY 482.A O no hydrogen 3.222 N/A ALA 488.A N ASN 164.A OD1 no hydrogen 3.093 N/A ALA 492.A N ASP 489.A OD1 no hydrogen 3.098 N/A GLU 493.A N ASP 489.A O no hydrogen 2.839 N/A ARG 494.A N LEU 490.A O no hydrogen 2.917 N/A ARG 494.A NE GLU 498.A OE2 no hydrogen 3.209 N/A ARG 494.A NH1 ASP 507.A OD1 no hydrogen 2.605 N/A ARG 494.A NH2 VAL 505.A O no hydrogen 2.568 N/A ARG 494.A NH2 ASP 507.A OD1 no hydrogen 3.020 N/A LYS 495.A N ASP 491.A O no hydrogen 3.216 N/A VAL 496.A N ALA 492.A O no hydrogen 2.952 N/A ILE 497.A N GLU 493.A O no hydrogen 3.148 N/A GLU 498.A N ARG 494.A O no hydrogen 2.864 N/A LYS 499.A N LYS 495.A O no hydrogen 2.984 N/A LYS 499.A N VAL 496.A O no hydrogen 3.062 N/A LYS 500.A N VAL 496.A O no hydrogen 3.072 N/A LEU 501.A N ILE 497.A O no hydrogen 3.146 N/A GLU 502.A N LYS 499.A O no hydrogen 3.360 N/A ARG 503.A N GLU 498.A O no hydrogen 3.146 N/A ARG 503.A NH1 GLU 504.A O no hydrogen 2.996 N/A ARG 503.A NH1 GLU 509.A OE1 no hydrogen 3.035 N/A ARG 503.A NH1 GLU 509.A OE2 no hydrogen 3.333 N/A ARG 503.A NH2 GLU 509.A OE2 no hydrogen 2.897 N/A VAL 505.A N GLU 498.A OE2 no hydrogen 3.029 N/A SER 506.A N GLU 509.A OE1 no hydrogen 2.858 N/A GLU 509.A N SER 506.A OG no hydrogen 3.181 N/A PHE 510.A N SER 506.A O no hydrogen 2.908 N/A ALA 511.A N ASP 507.A O no hydrogen 3.064 N/A SER 512.A N PHE 508.A O no hydrogen 2.963 N/A SER 512.A OG PHE 508.A O no hydrogen 3.422 N/A TYR 513.A N GLU 509.A O no hydrogen 2.902 N/A LEU 514.A N PHE 510.A O no hydrogen 2.764 N/A MET 515.A N ALA 511.A O no hydrogen 3.012 N/A MET 515.A N SER 512.A O no hydrogen 3.069 N/A TYR 516.A N SER 512.A O no hydrogen 2.744 N/A TYR 516.A OH VAL 156.A O no hydrogen 2.771 N/A PHE 520.A N TYR 516.A O no hydrogen 2.788 N/A THR 521.A N PRO 517.A O no hydrogen 3.046 N/A THR 521.A OG1 PRO 517.A O no hydrogen 2.569 N/A ASP 522.A N LYS 518.A O no hydrogen 2.862 N/A PHE 523.A N VAL 519.A O no hydrogen 2.781 N/A ALA 524.A N PHE 520.A O no hydrogen 2.827 N/A LEU 525.A N THR 521.A O no hydrogen 2.987 N/A ALA 526.A N ASP 522.A O no hydrogen 2.939 N/A SER 527.A N PHE 523.A O no hydrogen 2.940 N/A SER 527.A OG PHE 523.A O no hydrogen 3.565 N/A ASP 528.A N ALA 524.A O no hydrogen 3.139 N/A THR 529.A N LEU 525.A O no hydrogen 3.179 N/A THR 529.A OG1 LEU 525.A O no hydrogen 3.146 N/A TYR 530.A N ALA 526.A O no hydrogen 2.685 N/A TYR 530.A OH ASP 12.A OD2 no hydrogen 3.185 N/A GLY 531.A N SER 527.A O no hydrogen 2.933 N/A VAL 533.A N GLY 531.A O no hydrogen 3.033 N/A SER 534.A OG GLU 132.A OE1 no hydrogen 2.763 N/A SER 534.A OG GLU 132.A OE2 no hydrogen 2.953 N/A VAL 535.A N PRO 532.A O no hydrogen 3.032 N/A LEU 536.A N VAL 533.A O no hydrogen 2.936 N/A THR 538.A OG1 ASP 93.A OD2 no hydrogen 2.633 N/A TYR 541.A N PRO 537.A O no hydrogen 2.968 N/A TYR 541.A OH HIS 18.A NE2 no hydrogen 3.115 N/A TYR 541.A OH PHE 125.A O no hydrogen 3.306 N/A TYR 541.A OH THR 127.A OG1 no hydrogen 2.807 N/A PHE 542.A N THR 538.A O no hydrogen 3.077 N/A PHE 542.A N PRO 539.A O no hydrogen 3.212 N/A TYR 543.A N PRO 539.A O no hydrogen 2.765 N/A GLY 544.A N ALA 540.A O no hydrogen 2.879 N/A LEU 545.A N THR 14.A OG1 no hydrogen 2.869 N/A ALA 546.A N GLU 549.A OE1 no hydrogen 2.893 N/A GLY 548.A N ASN 563.A O no hydrogen 2.862 N/A GLU 549.A N ALA 546.A O no hydrogen 2.937 N/A LEU 551.A N ILE 561.A O no hydrogen 2.837 N/A ALA 553.A N LEU 559.A O no hydrogen 2.765 N/A THR 558.A OG1 ASP 554.A OD2 no hydrogen 2.186 N/A LEU 559.A N ALA 553.A O no hydrogen 2.509 N/A VAL 560.A N ASN 582.A OD1 no hydrogen 3.043 N/A ILE 561.A N LEU 551.A O no hydrogen 2.816 N/A VAL 562.A N GLU 580.A O no hydrogen 2.856 N/A ASN 563.A N GLU 549.A O no hydrogen 3.046 N/A ASN 563.A ND2 LEU 545.A O no hydrogen 3.006 N/A GLN 564.A N PHE 578.A O no hydrogen 2.945 N/A SER 567.A N THR 576.A O no hydrogen 3.012 N/A SER 567.A OG ALA 568.A O no hydrogen 2.975 N/A SER 567.A OG THR 576.A O no hydrogen 3.327 N/A THR 569.A OG1 ASP 592.A OD2 no hydrogen 2.604 N/A ASP 570.A N MET 574.A O no hydrogen 2.686 N/A SER 571.A OG GLN 572.A OE1 no hydrogen 3.342 N/A GLN 572.A N ASP 570.A OD1 no hydrogen 3.088 N/A GLY 573.A N ASP 570.A O no hydrogen 2.979 N/A MET 574.A N ASP 570.A OD1 no hydrogen 2.458 N/A VAL 575.A N VAL 590.A O no hydrogen 2.775 N/A THR 576.A N SER 567.A OG no hydrogen 2.841 N/A VAL 577.A N ILE 588.A O no hydrogen 2.895 N/A PHE 578.A N ALA 565.A O no hydrogen 3.021 N/A PHE 579.A N ARG 586.A O no hydrogen 2.878 N/A GLU 580.A N VAL 562.A O no hydrogen 2.859 N/A LEU 581.A N GLN 584.A O no hydrogen 2.649 N/A ASN 582.A N VAL 560.A O no hydrogen 2.892 N/A GLN 584.A N LEU 581.A O no hydrogen 2.846 N/A ARG 586.A N PHE 579.A O no hydrogen 2.916 N/A ARG 586.A NH2 THR 4.A OG1 no hydrogen 2.620 N/A ILE 588.A N VAL 577.A O no hydrogen 2.784 N/A VAL 590.A N VAL 575.A O no hydrogen 2.952 N/A ASP 592.A N GLY 573.A O no hydrogen 2.685 N/A ARG 593.A NE ASP 12.A OD1 no hydrogen 3.258 N/A ARG 593.A NH2 ASP 12.A OD1 no hydrogen 3.265 N/A ARG 593.A NH2 ASP 12.A OD2 no hydrogen 2.639 N/A ALA 594.A N ASP 592.A OD1 no hydrogen 3.238 N/A